data_nef_c19978_2mpg save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MPG stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 6 CYS SG 1 11 CYS SG 1 7 CYS SG 2 7 CYS SG 1 20 CYS SG 2 19 CYS SG 2 7 CYS C 2 8 AIB N 2 8 AIB C 2 9 SER N 1 6 CYS SG 1 11 CYS SG 1 7 CYS SG 2 7 CYS SG stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 ILE middle . . 3 A 3 VAL middle . . 4 A 4 GLU middle . . 5 A 5 GLN middle . . 6 A 6 CYS middle -HG . 7 A 7 CYS middle -HG . 8 A 8 THR middle . . 9 A 9 SER middle . . 10 A 10 ILE middle . . 11 A 11 CYS middle -HG . 12 A 12 SER middle . . 13 A 13 LEU middle . . 14 A 14 TYR middle . . 15 A 15 GLN middle . . 16 A 16 LEU middle . . 17 A 17 GLU middle . . 18 A 18 ASN middle . . 19 A 19 TYR middle . . 20 A 20 CYS middle -HG . 21 A 21 ASN end . . 22 B 1 PHE start . . 23 B 2 VAL middle . . 24 B 3 ASN middle . . 25 B 4 GLN middle . . 26 B 5 HIS middle . . 27 B 6 LEU middle . . 28 B 7 CYS middle -HG . 29 B 8 AIB middle . . 30 B 9 SER middle . . 31 B 10 HIS middle . . 32 B 11 LEU middle . . 33 B 12 VAL middle . . 34 B 13 GLU middle . . 35 B 14 ALA middle . . 36 B 15 LEU middle . . 37 B 16 TYR middle . . 38 B 17 LEU middle . . 39 B 18 VAL middle . . 40 B 19 CYS middle -HG . 41 B 20 GLY middle . false 42 B 21 GLU middle . . 43 B 22 ARG middle . . 44 B 23 GLY middle . false 45 B 24 PHE middle . . 46 B 25 PHE middle . . 47 B 26 TYR middle . . 48 B 27 THR middle . . 49 B 28 LYS middle . . 50 B 29 PRO middle . false 51 B 30 THR end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HAx H 1 4.044 0.010 A 1 GLY HAy H 1 4.044 0.010 A 2 ILE H H 1 8.556 0.011 A 2 ILE HA H 1 3.982 0.010 A 2 ILE HB H 1 0.787 0.010 A 2 ILE HD1% H 1 0.641 0.010 A 2 ILE HG1x H 1 1.199 0.010 A 2 ILE HG1y H 1 1.199 0.010 A 2 ILE HG2% H 1 0.975 0.010 A 3 VAL H H 1 8.158 0.011 A 3 VAL HA H 1 3.657 0.013 A 3 VAL HB H 1 1.927 0.010 A 3 VAL HGx% H 1 0.938 0.010 A 3 VAL HGy% H 1 0.894 0.010 A 4 GLU H H 1 8.093 0.016 A 4 GLU HA H 1 4.230 0.015 A 4 GLU HBx H 1 2.118 0.010 A 4 GLU HBy H 1 2.118 0.010 A 4 GLU HGx H 1 2.493 0.010 A 4 GLU HGy H 1 2.493 0.010 A 5 GLN H H 1 8.265 0.011 A 5 GLN HA H 1 4.115 0.012 A 5 GLN HBx H 1 2.123 0.010 A 5 GLN HBy H 1 2.123 0.010 A 5 GLN HGx H 1 2.419 0.010 A 5 GLN HGy H 1 2.492 0.010 A 6 CYS H H 1 8.320 0.013 A 6 CYS HA H 1 4.974 0.010 A 6 CYS HBx H 1 2.868 0.016 A 6 CYS HBy H 1 3.374 0.010 A 7 CYS H H 1 8.255 0.010 A 7 CYS HA H 1 4.882 0.010 A 7 CYS HBx H 1 3.338 0.010 A 7 CYS HBy H 1 3.703 0.010 A 8 THR H H 1 8.250 0.010 A 8 THR HA H 1 4.136 0.011 A 8 THR HB H 1 4.424 0.015 A 8 THR HG2% H 1 1.257 0.011 A 9 SER H H 1 7.478 0.010 A 9 SER HA H 1 4.769 0.011 A 9 SER HBy H 1 4.033 0.016 A 9 SER HBx H 1 3.900 0.012 A 10 ILE H H 1 7.915 0.012 A 10 ILE HA H 1 4.364 0.014 A 10 ILE HB H 1 1.636 0.011 A 10 ILE HD1% H 1 0.584 0.011 A 10 ILE HG1x H 1 1.189 0.010 A 10 ILE HG1y H 1 1.189 0.010 A 10 ILE HG2% H 1 0.695 0.010 A 11 CYS H H 1 9.622 0.010 A 12 SER H H 1 8.822 0.010 A 12 SER HA H 1 4.607 0.010 A 12 SER HBy H 1 4.334 0.011 A 12 SER HBx H 1 4.033 0.010 A 13 LEU H H 1 8.677 0.011 A 13 LEU HA H 1 3.887 0.010 A 13 LEU HBx H 1 1.389 0.010 A 13 LEU HBy H 1 1.389 0.010 A 13 LEU HDx% H 1 0.770 0.010 A 13 LEU HDy% H 1 0.831 0.011 A 13 LEU HG H 1 1.452 0.010 A 14 TYR H H 1 7.545 0.014 A 14 TYR HA H 1 4.180 0.011 A 14 TYR HBx H 1 2.935 0.011 A 14 TYR HBy H 1 3.008 0.011 A 14 TYR HDx H 1 7.079 0.012 A 14 TYR HDy H 1 7.079 0.012 A 14 TYR HEx H 1 6.853 0.010 A 14 TYR HEy H 1 6.853 0.010 A 15 GLN H H 1 7.578 0.011 A 15 GLN HA H 1 4.005 0.012 A 15 GLN HBx H 1 2.052 0.010 A 15 GLN HBy H 1 2.407 0.010 A 15 GLN HE2x H 1 6.985 0.010 A 15 GLN HGy H 1 2.471 0.012 A 15 GLN HGx H 1 2.409 0.010 A 16 LEU H H 1 8.122 0.013 A 16 LEU HA H 1 4.193 0.013 A 16 LEU HBx H 1 1.759 0.010 A 16 LEU HBy H 1 1.953 0.010 A 16 LEU HDx% H 1 0.836 0.010 A 16 LEU HDy% H 1 0.836 0.010 A 16 LEU HG H 1 1.575 0.010 A 17 GLU H H 1 8.102 0.010 A 17 GLU HA H 1 4.209 0.013 A 17 GLU HBx H 1 2.049 0.010 A 17 GLU HBy H 1 2.144 0.010 A 17 GLU HGy H 1 2.597 0.010 A 17 GLU HGx H 1 2.368 0.010 A 18 ASN H H 1 7.427 0.011 A 18 ASN HA H 1 4.494 0.013 A 18 ASN HBy H 1 2.635 0.011 A 18 ASN HBx H 1 2.557 0.010 A 18 ASN HD2x H 1 6.577 0.010 A 18 ASN HD2y H 1 7.189 0.010 A 19 TYR H H 1 7.945 0.011 A 19 TYR HA H 1 4.443 0.012 A 19 TYR HBy H 1 3.386 0.014 A 19 TYR HBx H 1 2.976 0.011 A 19 TYR HDx H 1 7.353 0.010 A 19 TYR HDy H 1 7.353 0.010 A 19 TYR HEx H 1 6.788 0.012 A 19 TYR HEy H 1 6.788 0.012 A 20 CYS H H 1 7.423 0.012 A 20 CYS HA H 1 4.943 0.016 A 20 CYS HBx H 1 2.854 0.011 A 20 CYS HBy H 1 3.271 0.013 A 21 ASN H H 1 8.294 0.011 A 21 ASN HA H 1 4.746 0.010 A 21 ASN HBy H 1 2.895 0.016 A 21 ASN HBx H 1 2.757 0.011 A 21 ASN HD2y H 1 7.530 0.010 A 21 ASN HD2x H 1 6.674 0.011 B 1 PHE HA H 1 4.290 0.011 B 1 PHE HBx H 1 3.185 0.012 B 1 PHE HBy H 1 3.185 0.012 B 1 PHE HDx H 1 7.243 0.012 B 1 PHE HDy H 1 7.243 0.012 B 1 PHE HEx H 1 7.380 0.010 B 1 PHE HEy H 1 7.380 0.010 B 2 VAL H H 1 8.215 0.012 B 2 VAL HA H 1 4.135 0.012 B 2 VAL HB H 1 1.925 0.012 B 2 VAL HGx% H 1 0.877 0.015 B 2 VAL HGy% H 1 0.877 0.015 B 3 ASN H H 1 8.521 0.011 B 3 ASN HA H 1 4.731 0.010 B 3 ASN HBx H 1 2.770 0.012 B 3 ASN HBy H 1 2.770 0.012 B 3 ASN HD2y H 1 7.613 0.010 B 3 ASN HD2x H 1 6.973 0.010 B 4 GLN H H 1 8.530 0.012 B 4 GLN HA H 1 4.444 0.013 B 4 GLN HBy H 1 2.115 0.010 B 4 GLN HBx H 1 1.950 0.010 B 4 GLN HE2y H 1 7.092 0.010 B 4 GLN HE2x H 1 6.803 0.010 B 4 GLN HGy H 1 2.298 0.010 B 4 GLN HGx H 1 2.202 0.010 B 5 HIS H H 1 8.660 0.014 B 5 HIS HA H 1 4.485 0.012 B 5 HIS HBy H 1 3.537 0.011 B 5 HIS HBx H 1 3.293 0.012 B 5 HIS HD2 H 1 7.397 0.010 B 5 HIS HE1 H 1 8.623 0.010 B 6 LEU H H 1 8.448 0.015 B 6 LEU HA H 1 4.278 0.012 B 6 LEU HBx H 1 1.841 0.013 B 6 LEU HBy H 1 1.841 0.013 B 6 LEU HDx% H 1 0.902 0.010 B 6 LEU HDy% H 1 0.902 0.010 B 6 LEU HG H 1 1.469 0.010 B 7 CYS H H 1 8.255 0.012 B 7 CYS HBy H 1 3.204 0.010 B 7 CYS HBx H 1 3.070 0.010 B 8 AIB H H 1 9.120 0.018 B 8 AIB HBx% H 1 1.484 0.011 B 8 AIB HBy% H 1 1.637 0.013 B 9 SER H H 1 7.982 0.011 B 9 SER HA H 1 4.099 0.011 B 9 SER HBy H 1 3.964 0.010 B 9 SER HBx H 1 3.930 0.010 B 10 HIS H H 1 8.079 0.012 B 10 HIS HA H 1 4.545 0.013 B 10 HIS HBy H 1 3.583 0.014 B 10 HIS HBx H 1 3.332 0.012 B 10 HIS HD2 H 1 7.450 0.013 B 10 HIS HE1 H 1 8.729 0.010 B 11 LEU HA H 1 4.035 0.012 B 11 LEU HBx H 1 1.404 0.010 B 11 LEU HDx% H 1 0.799 0.010 B 11 LEU HDy% H 1 0.734 0.012 B 11 LEU HG H 1 1.328 0.010 B 12 VAL H H 1 7.643 0.011 B 12 VAL HA H 1 3.333 0.010 B 12 VAL HB H 1 2.066 0.010 B 12 VAL HGx% H 1 0.966 0.011 B 12 VAL HGy% H 1 0.966 0.011 B 13 GLU H H 1 7.908 0.012 B 13 GLU HA H 1 4.145 0.013 B 13 GLU HBy H 1 2.206 0.010 B 13 GLU HBx H 1 2.117 0.010 B 13 GLU HGy H 1 2.583 0.010 B 13 GLU HGx H 1 2.370 0.010 B 14 ALA H H 1 7.735 0.012 B 14 ALA HA H 1 4.122 0.011 B 14 ALA HB% H 1 1.496 0.010 B 15 LEU H H 1 8.171 0.010 B 15 LEU HA H 1 3.885 0.011 B 15 LEU HBx H 1 1.316 0.010 B 15 LEU HBy H 1 1.316 0.010 B 15 LEU HDx% H 1 0.456 0.010 B 15 LEU HDy% H 1 0.683 0.015 B 15 LEU HG H 1 1.510 0.010 B 16 TYR H H 1 8.141 0.012 B 16 TYR HA H 1 4.297 0.010 B 16 TYR HBx H 1 3.165 0.011 B 16 TYR HBy H 1 3.165 0.011 B 16 TYR HDx H 1 7.173 0.013 B 16 TYR HDy H 1 7.173 0.013 B 16 TYR HEx H 1 6.803 0.012 B 16 TYR HEy H 1 6.803 0.012 B 17 LEU H H 1 7.798 0.014 B 17 LEU HA H 1 4.111 0.010 B 17 LEU HBy H 1 1.953 0.014 B 17 LEU HBx H 1 1.685 0.013 B 17 LEU HDx% H 1 0.961 0.010 B 17 LEU HDy% H 1 0.961 0.010 B 17 LEU HG H 1 1.857 0.015 B 18 VAL H H 1 8.557 0.011 B 18 VAL HA H 1 3.883 0.011 B 18 VAL HB H 1 2.112 0.016 B 18 VAL HGx% H 1 1.036 0.010 B 18 VAL HGy% H 1 0.897 0.011 B 19 CYS H H 1 8.755 0.011 B 19 CYS HA H 1 4.805 0.010 B 19 CYS HBy H 1 3.281 0.013 B 19 CYS HBx H 1 2.953 0.012 B 20 GLY H H 1 7.718 0.012 B 20 GLY HAx H 1 3.968 0.011 B 20 GLY HAy H 1 3.968 0.011 B 21 GLU H H 1 8.544 0.011 B 21 GLU HA H 1 4.245 0.013 B 21 GLU HBx H 1 2.110 0.010 B 21 GLU HBy H 1 2.110 0.010 B 21 GLU HGx H 1 2.213 0.010 B 21 GLU HGy H 1 2.552 0.010 B 22 ARG H H 1 8.030 0.013 B 22 ARG HA H 1 4.222 0.012 B 22 ARG HBx H 1 1.996 0.010 B 22 ARG HBy H 1 1.996 0.010 B 22 ARG HDx H 1 3.287 0.011 B 22 ARG HDy H 1 3.287 0.011 B 22 ARG HE H 1 7.145 0.010 B 22 ARG HGy H 1 1.800 0.010 B 22 ARG HGx H 1 1.775 0.010 B 23 GLY H H 1 7.654 0.011 B 23 GLY HAy H 1 4.045 0.012 B 23 GLY HAx H 1 3.848 0.011 B 24 PHE H H 1 7.726 0.011 B 24 PHE HA H 1 4.894 0.014 B 24 PHE HBy H 1 3.155 0.012 B 24 PHE HBx H 1 2.931 0.015 B 24 PHE HDx H 1 6.896 0.011 B 24 PHE HDy H 1 6.896 0.011 B 24 PHE HEx H 1 7.045 0.010 B 24 PHE HEy H 1 7.045 0.010 B 25 PHE H H 1 8.348 0.012 B 25 PHE HA H 1 4.704 0.012 B 25 PHE HBy H 1 3.140 0.014 B 25 PHE HBx H 1 3.070 0.011 B 25 PHE HDx H 1 7.201 0.012 B 25 PHE HDy H 1 7.201 0.012 B 25 PHE HEx H 1 7.290 0.010 B 25 PHE HEy H 1 7.290 0.010 B 26 TYR H H 1 8.040 0.013 B 26 TYR HA H 1 4.639 0.012 B 26 TYR HBy H 1 2.985 0.016 B 26 TYR HBx H 1 2.958 0.011 B 26 TYR HDx H 1 7.049 0.012 B 26 TYR HDy H 1 7.049 0.012 B 26 TYR HEx H 1 6.761 0.010 B 26 TYR HEy H 1 6.761 0.010 B 27 THR H H 1 7.822 0.012 B 27 THR HA H 1 4.346 0.010 B 27 THR HB H 1 4.109 0.011 B 27 THR HG2% H 1 1.165 0.010 B 28 LYS H H 1 8.209 0.011 B 28 LYS HA H 1 4.497 0.013 B 28 LYS HBy H 1 1.832 0.010 B 28 LYS HBx H 1 1.747 0.010 B 28 LYS HDx H 1 1.697 0.010 B 28 LYS HDy H 1 1.697 0.010 B 28 LYS HEx H 1 3.006 0.012 B 28 LYS HEy H 1 3.006 0.012 B 28 LYS HGx H 1 1.472 0.010 B 28 LYS HGy H 1 1.472 0.010 B 29 PRO HA H 1 4.525 0.011 B 29 PRO HBx H 1 2.297 0.012 B 29 PRO HBy H 1 2.297 0.012 B 29 PRO HDy H 1 3.816 0.012 B 29 PRO HDx H 1 3.655 0.011 B 29 PRO HGx H 1 1.985 0.010 B 29 PRO HGy H 1 1.985 0.010 B 30 THR H H 1 8.114 0.013 B 30 THR HA H 1 4.433 0.010 B 30 THR HB H 1 4.403 0.010 B 30 THR HG2% H 1 1.231 0.010 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 21 GLU H B 20 GLY HAx 1.0 0.0 3.28 2 1 B 20 GLY HAy B 21 GLU H 1.0 0.0 3.28 3 2 A 2 ILE H A 1 GLY HAx 1.0 0.0 3.51 4 3 A 2 ILE H A 1 GLY HAy 1.0 0.0 3.51 5 4 A 3 VAL HA A 4 GLU H 1.0 0.0 3.10 6 5 A 4 GLU HA A 5 GLN H 1.0 0.0 3.56 7 6 A 5 GLN HA A 6 CYS H 1.0 0.0 2.98 8 7 B 2 VAL HA B 3 ASN H 1.0 0.0 2.81 9 8 B 1 PHE HA B 2 VAL H 1.0 0.0 3.03 10 9 B 19 CYS H B 19 CYS HBy 1.0 0.0 3.74 11 10 B 19 CYS H B 19 CYS HBx 1.0 0.0 3.74 12 11 B 5 HIS H B 5 HIS HBy 1.0 0.0 3.88 13 12 B 5 HIS H B 5 HIS HBx 1.0 0.0 3.88 14 13 B 3 ASN H B 3 ASN HBx 1.0 0.0 3.12 15 13 B 3 ASN H B 3 ASN HBy 1.0 0.0 3.12 16 14 A 4 GLU H A 4 GLU HBx 1.0 0.0 4.17 17 15 A 4 GLU H A 4 GLU HBy 1.0 0.0 4.17 18 16 B 20 GLY H B 19 CYS HBx 1.0 0.0 4.30 19 17 B 10 HIS H B 10 HIS HBy 1.0 0.0 3.71 20 18 B 10 HIS H B 10 HIS HBx 1.0 0.0 3.71 21 19 B 10 HIS HA B 13 GLU H 1.0 0.0 4.38 22 20 B 13 GLU HA B 16 TYR HD% 1.0 0.0 4.29 23 21 A 7 CYS HA A 8 THR H 1.0 0.0 3.00 24 22 B 16 TYR H B 16 TYR HBx 1.0 0.0 2.97 25 22 B 16 TYR H B 16 TYR HBy 1.0 0.0 2.97 26 23 B 17 LEU H B 16 TYR HBx 1.0 0.0 4.02 27 23 B 16 TYR HBy B 17 LEU H 1.0 0.0 4.02 28 24 B 14 ALA HA B 18 VAL H 1.0 0.0 4.47 29 25 A 5 GLN H A 5 GLN HGx 1.0 0.0 3.84 30 26 A 6 CYS H A 5 GLN HGx 1.0 0.0 4.11 31 27 B 19 CYS H B 18 VAL H 1.0 0.0 3.55 32 28 B 19 CYS H B 20 GLY H 1.0 0.0 3.45 33 29 B 5 HIS H B 5 HIS HD2 1.0 0.0 4.10 34 30 B 21 GLU H B 22 ARG H 1.0 0.0 3.80 35 31 B 20 GLY H B 18 VAL H 1.0 0.0 5.12 36 32 B 21 GLU H B 20 GLY H 1.0 0.0 5.46 37 33 B 3 ASN H B 2 VAL H 1.0 0.0 4.77 38 34 A 2 ILE H A 3 VAL H 1.0 0.0 4.68 39 35 A 2 ILE HA A 2 ILE HD1% 1.0 0.0 3.91 40 36 A 2 ILE H A 2 ILE HD1% 1.0 0.0 3.71 41 37 A 3 VAL H A 2 ILE HD1% 1.0 0.0 4.30 42 38 A 4 GLU H A 3 VAL H 1.0 0.0 4.76 43 39 B 10 HIS H B 9 SER H 1.0 0.0 3.86 44 40 B 3 ASN HA B 4 GLN H 1.0 0.0 3.46 45 41 B 19 CYS H B 20 GLY HAx 1.0 0.0 4.76 46 41 B 20 GLY HAy B 19 CYS H 1.0 0.0 4.76 47 42 B 19 CYS H B 16 TYR HA 1.0 0.0 4.75 48 43 B 3 ASN HD2y B 3 ASN HBx 1.0 0.0 3.93 49 43 B 3 ASN HBy B 3 ASN HD2y 1.0 0.0 3.93 50 44 B 3 ASN HD2x B 3 ASN HBx 1.0 0.0 3.93 51 44 B 3 ASN HBy B 3 ASN HD2x 1.0 0.0 3.93 52 45 B 5 HIS H B 4 GLN HBx 1.0 0.0 4.16 53 46 B 14 ALA H B 15 LEU H 1.0 0.0 3.78 54 47 B 13 GLU H B 12 VAL HGx% 1.0 0.0 4.02 55 47 B 13 GLU H B 12 VAL HGy% 1.0 0.0 4.02 56 48 B 22 ARG HE B 22 ARG HBx 1.0 0.0 4.16 57 48 B 22 ARG HBy B 22 ARG HE 1.0 0.0 4.16 58 49 B 16 TYR H B 17 LEU H 1.0 0.0 4.20 59 50 B 17 LEU H B 18 VAL H 1.0 0.0 4.32 60 51 B 17 LEU H B 17 LEU HG 1.0 0.0 4.31 61 52 A 2 ILE HD1% B 19 CYS HBy 1.0 0.0 4.59 62 53 B 17 LEU H B 17 LEU HDx% 1.0 0.0 4.72 63 53 B 17 LEU H B 17 LEU HDy% 1.0 0.0 4.72 64 54 B 7 CYS H B 7 CYS HBy 1.0 0.0 4.02 65 55 B 7 CYS H B 7 CYS HBx 1.0 0.0 4.02 66 56 B 16 TYR HD% B 16 TYR H 1.0 0.0 4.40 67 57 B 2 VAL H B 1 PHE HD% 1.0 0.0 4.90 68 58 B 22 ARG H B 22 ARG HE 1.0 0.0 5.03 69 59 B 10 HIS H B 10 HIS HD2 1.0 0.0 3.96 70 60 B 13 GLU H B 14 ALA H 1.0 0.0 4.23 71 61 B 13 GLU H B 12 VAL H 1.0 0.0 4.41 72 62 B 20 GLY H B 22 ARG H 1.0 0.0 5.15 73 63 A 5 GLN H A 6 CYS H 1.0 0.0 4.38 74 64 A 4 GLU H A 5 GLN H 1.0 0.0 4.32 75 65 B 16 TYR HD% B 17 LEU HG 1.0 0.0 4.26 76 66 B 9 SER H B 8 ABA HBx 1.0 0.0 2.81 77 67 B 15 LEU H B 15 LEU HDx% 1.0 0.0 4.63 78 68 A 2 ILE HD1% B 15 LEU HDx% 1.0 0.0 4.37 79 69 B 19 CYS H B 18 VAL HGy% 1.0 0.0 3.89 80 70 B 18 VAL H B 18 VAL HGy% 1.0 0.0 3.86 81 71 B 3 ASN H B 2 VAL HGx% 1.0 0.0 3.73 82 71 B 3 ASN H B 2 VAL HGy% 1.0 0.0 3.73 83 72 B 2 VAL H B 2 VAL HGx% 1.0 0.0 3.59 84 72 B 2 VAL H B 2 VAL HGy% 1.0 0.0 3.59 85 73 B 15 LEU H B 15 LEU HDy% 1.0 0.0 4.63 86 74 A 2 ILE HD1% B 15 LEU HDy% 1.0 0.0 4.37 87 75 B 12 VAL H B 12 VAL HGx% 1.0 0.0 3.39 88 75 B 12 VAL HGy% B 12 VAL H 1.0 0.0 3.39 89 76 B 16 TYR HD% B 17 LEU HDx% 1.0 0.0 3.75 90 76 B 16 TYR HD% B 17 LEU HDy% 1.0 0.0 3.75 91 77 B 19 CYS H B 18 VAL HGx% 1.0 0.0 4.13 92 78 B 18 VAL H B 18 VAL HGx% 1.0 0.0 3.23 93 79 B 14 ALA H B 17 LEU HDx% 1.0 0.0 4.96 94 79 B 14 ALA H B 17 LEU HDy% 1.0 0.0 4.96 95 80 B 15 LEU H B 15 LEU HBx 1.0 0.0 3.98 96 80 B 15 LEU H B 15 LEU HBy 1.0 0.0 3.98 97 81 B 16 TYR H B 15 LEU HBx 1.0 0.0 4.45 98 81 B 16 TYR H B 15 LEU HBy 1.0 0.0 4.45 99 82 A 8 THR H A 8 THR HG2% 1.0 0.0 4.42 100 83 B 10 HIS HD2 B 8 ABA HBx 1.0 0.0 4.96 101 84 A 2 ILE HD1% B 15 LEU HBx 1.0 0.0 4.92 102 84 A 2 ILE HD1% B 15 LEU HBy 1.0 0.0 4.92 103 85 A 6 CYS H A 6 CYS HBy 1.0 0.0 4.01 104 86 A 6 CYS H A 6 CYS HBx 1.0 0.0 4.01 105 87 B 18 VAL H B 17 LEU HBx 1.0 0.0 4.32 106 88 B 16 TYR HE% B 21 GLU HBx 1.0 0.0 5.42 107 88 B 16 TYR HE% B 21 GLU HBy 1.0 0.0 5.42 108 89 B 12 VAL H B 12 VAL HB 1.0 0.0 3.90 109 90 B 14 ALA H B 13 GLU HBy 1.0 0.0 4.07 110 91 B 14 ALA H B 13 GLU HBx 1.0 0.0 4.07 111 92 B 13 GLU H B 13 GLU HBy 1.0 0.0 3.93 112 93 B 13 GLU H B 13 GLU HBx 1.0 0.0 3.93 113 94 B 13 GLU H B 12 VAL HB 1.0 0.0 3.93 114 95 B 22 ARG H B 22 ARG HBx 1.0 0.0 3.41 115 95 B 22 ARG H B 22 ARG HBy 1.0 0.0 3.41 116 96 B 10 HIS H B 8 ABA HBx 1.0 0.0 4.10 117 97 B 22 ARG H B 22 ARG HGy 1.0 0.0 4.55 118 98 B 22 ARG H B 22 ARG HGx 1.0 0.0 4.55 119 99 B 4 GLN H B 4 GLN HBy 1.0 0.0 4.18 120 100 B 21 GLU H B 21 GLU HBx 1.0 0.0 3.90 121 100 B 21 GLU H B 21 GLU HBy 1.0 0.0 3.90 122 101 B 21 GLU H B 21 GLU HGx 1.0 0.0 4.17 123 102 B 5 HIS H B 4 GLN HBy 1.0 0.0 4.16 124 103 B 19 CYS H B 18 VAL HB 1.0 0.0 4.13 125 104 B 21 GLU H B 21 GLU HGy 1.0 0.0 4.17 126 105 B 15 LEU H B 12 VAL HA 1.0 0.0 4.40 127 106 A 5 GLN H A 4 GLU HBy 1.0 0.0 4.77 128 107 A 5 GLN H A 4 GLU HBx 1.0 0.0 4.77 129 108 B 20 GLY H B 19 CYS HBy 1.0 0.0 4.30 130 109 B 22 ARG H B 22 ARG HDx 1.0 0.0 4.24 131 109 B 22 ARG H B 22 ARG HDy 1.0 0.0 4.24 132 110 B 18 VAL H B 16 TYR HBx 1.0 0.0 5.28 133 110 B 16 TYR HBy B 18 VAL H 1.0 0.0 5.28 134 111 B 16 TYR HE% B 20 GLY HAx 1.0 0.0 5.50 135 111 B 20 GLY HAy B 16 TYR HE% 1.0 0.0 5.50 136 112 A 2 ILE HD1% B 16 TYR HA 1.0 0.0 4.42 137 113 B 16 TYR HA B 16 TYR HE% 1.0 0.0 4.68 138 114 B 16 TYR HE% B 21 GLU HA 1.0 0.0 4.77 139 115 B 16 TYR HD% B 16 TYR HA 1.0 0.0 3.45 140 116 B 1 PHE HA B 1 PHE HD% 1.0 0.0 3.84 141 117 B 9 SER H B 9 SER HBy 1.0 0.0 3.80 142 118 B 9 SER H B 9 SER HBx 1.0 0.0 3.80 143 119 B 15 LEU H B 11 LEU HA 1.0 0.0 4.84 144 120 B 20 GLY H B 21 GLU HA 1.0 0.0 5.30 145 121 B 20 GLY H B 16 TYR HA 1.0 0.0 4.31 146 122 B 10 HIS HA B 14 ALA H 1.0 0.0 5.03 147 123 A 3 VAL HA A 2 ILE HD1% 1.0 0.0 4.96 148 124 A 4 GLU H A 2 ILE HD1% 1.0 0.0 5.41 149 125 B 16 TYR HD% B 17 LEU H 1.0 0.0 4.93 150 126 B 13 GLU H B 15 LEU H 1.0 0.0 4.80 151 127 B 21 GLU HA B 20 GLY HAx 1.0 0.0 4.35 152 127 B 20 GLY HAy B 21 GLU HA 1.0 0.0 4.35 153 128 B 22 ARG HA B 22 ARG HDx 1.0 0.0 3.90 154 128 B 22 ARG HDy B 22 ARG HA 1.0 0.0 3.90 155 129 B 13 GLU HA B 16 TYR HBx 1.0 0.0 3.21 156 129 B 13 GLU HA B 16 TYR HBy 1.0 0.0 3.21 157 130 B 2 VAL HA B 3 ASN HBx 1.0 0.0 4.36 158 130 B 2 VAL HA B 3 ASN HBy 1.0 0.0 4.36 159 131 B 21 GLU HA B 21 GLU HGy 1.0 0.0 3.99 160 132 B 10 HIS HA B 13 GLU HBx 1.0 0.0 3.91 161 133 B 10 HIS HA B 13 GLU HBy 1.0 0.0 3.91 162 134 B 18 VAL HGy% B 19 CYS HA 1.0 0.0 4.32 163 135 B 3 ASN HA B 2 VAL HGx% 1.0 0.0 4.64 164 135 B 3 ASN HA B 2 VAL HGy% 1.0 0.0 4.64 165 136 B 21 GLU HA B 21 GLU HGx 1.0 0.0 3.99 166 137 B 11 LEU HA B 14 ALA HB% 1.0 0.0 3.61 167 138 B 11 LEU HA B 11 LEU HDx% 1.0 0.0 3.87 168 139 B 11 LEU HA B 11 LEU HDy% 1.0 0.0 3.87 169 140 A 5 GLN HA A 5 GLN HGx 1.0 0.0 4.01 170 141 B 17 LEU HG B 17 LEU HA 1.0 0.0 3.89 171 142 B 15 LEU HA B 15 LEU HG 1.0 0.0 3.98 172 143 B 18 VAL HGx% B 15 LEU HA 1.0 0.0 3.38 173 144 B 18 VAL HGx% B 18 VAL HA 1.0 0.0 3.77 174 145 B 18 VAL HGy% B 18 VAL HA 1.0 0.0 3.28 175 146 B 15 LEU HA B 15 LEU HDy% 1.0 0.0 4.11 176 147 B 8 ABA HBx B 9 SER HBy 1.0 0.0 5.08 177 148 B 12 VAL HA B 12 VAL HGx% 1.0 0.0 2.97 178 148 B 12 VAL HGy% B 12 VAL HA 1.0 0.0 2.97 179 149 B 12 VAL HA B 15 LEU HBx 1.0 0.0 4.27 180 149 B 15 LEU HBy B 12 VAL HA 1.0 0.0 4.27 181 150 B 22 ARG HBy B 22 ARG HDx 1.0 0.0 3.36 182 150 B 22 ARG HBx B 22 ARG HDx 1.0 0.0 3.36 183 150 B 22 ARG HDy B 22 ARG HBx 1.0 0.0 3.36 184 150 B 22 ARG HBy B 22 ARG HDy 1.0 0.0 3.36 185 151 B 8 ABA HBx B 7 CYS HBy 1.0 0.0 4.71 186 152 B 12 VAL HGy% B 16 TYR HBx 1.0 0.0 4.29 187 152 B 12 VAL HGx% B 16 TYR HBx 1.0 0.0 4.29 188 152 B 16 TYR HBy B 12 VAL HGx% 1.0 0.0 4.29 189 152 B 16 TYR HBy B 12 VAL HGy% 1.0 0.0 4.29 190 153 B 17 LEU HG B 16 TYR HBx 1.0 0.0 4.57 191 153 B 16 TYR HBy B 17 LEU HG 1.0 0.0 4.57 192 154 B 14 ALA H B 14 ALA HB% 1.0 0.0 3.10 193 155 B 15 LEU H B 14 ALA HB% 1.0 0.0 3.33 194 156 B 4 GLN H B 4 GLN HBx 1.0 0.0 4.18 195 157 B 18 VAL H B 17 LEU HBy 1.0 0.0 4.32 196 158 A 2 ILE HD1% B 19 CYS HBx 1.0 0.0 4.59 197 159 B 7 CYS H B 8 ABA HBx 1.0 0.0 5.50 198 160 B 8 ABA HBx B 9 SER HBx 1.0 0.0 5.08 199 161 B 6 LEU H B 6 LEU HDx% 1.0 0.0 4.22 200 161 B 6 LEU H B 6 LEU HDy% 1.0 0.0 4.22 201 162 B 6 LEU H B 6 LEU HBx 1.0 0.0 3.83 202 162 B 6 LEU H B 6 LEU HBy 1.0 0.0 3.83 203 163 B 6 LEU H B 6 LEU HG 1.0 0.0 4.57 204 164 B 22 ARG H B 20 GLY HAx 1.0 0.0 4.37 205 164 B 20 GLY HAy B 22 ARG H 1.0 0.0 4.37 206 165 B 18 VAL H B 17 LEU HG 1.0 0.0 4.83 207 166 B 2 VAL H B 2 VAL HB 1.0 0.0 3.95 208 167 B 15 LEU HA B 15 LEU HDx% 1.0 0.0 4.11 209 168 B 2 VAL HA B 2 VAL HGx% 1.0 0.0 3.16 210 168 B 2 VAL HA B 2 VAL HGy% 1.0 0.0 3.16 211 169 B 6 LEU HA B 6 LEU HDx% 1.0 0.0 3.44 212 169 B 6 LEU HDy% B 6 LEU HA 1.0 0.0 3.44 213 170 B 14 ALA HA B 17 LEU HDx% 1.0 0.0 3.17 214 170 B 14 ALA HA B 17 LEU HDy% 1.0 0.0 3.17 215 171 B 17 LEU HA B 17 LEU HDx% 1.0 0.0 3.33 216 171 B 17 LEU HDy% B 17 LEU HA 1.0 0.0 3.33 217 172 B 11 LEU HA B 12 VAL HGx% 1.0 0.0 5.50 218 172 B 12 VAL HGy% B 11 LEU HA 1.0 0.0 5.50 219 173 A 7 CYS HA A 8 THR HG2% 1.0 0.0 4.57 220 174 B 13 GLU HA B 16 TYR H 1.0 0.0 3.88 221 175 B 8 ABA HBx B 7 CYS HBx 1.0 0.0 4.71 222 176 B 3 ASN HD2x B 3 ASN HBx 1.0 0.0 3.39 223 176 B 3 ASN HD2y B 3 ASN HBx 1.0 0.0 3.39 224 176 B 3 ASN HBy B 3 ASN HD2y 1.0 0.0 3.39 225 176 B 3 ASN HBy B 3 ASN HD2x 1.0 0.0 3.39 226 177 B 4 GLN H B 4 GLN HBx 1.0 0.0 3.30 227 177 B 4 GLN H B 4 GLN HBy 1.0 0.0 3.30 228 178 B 4 GLN H B 4 GLN HGy 1.0 0.0 4.85 229 178 B 4 GLN H B 4 GLN HGx 1.0 0.0 4.85 230 179 B 4 GLN HA B 4 GLN HE2x 1.0 0.0 4.10 231 179 B 4 GLN HA B 4 GLN HE2y 1.0 0.0 4.10 232 180 B 4 GLN HBy B 4 GLN HE2x 1.0 0.0 4.36 233 180 B 4 GLN HBx B 4 GLN HE2x 1.0 0.0 4.36 234 180 B 4 GLN HE2y B 4 GLN HBx 1.0 0.0 4.36 235 180 B 4 GLN HBy B 4 GLN HE2y 1.0 0.0 4.36 236 181 B 5 HIS H B 4 GLN HBx 1.0 0.0 3.56 237 181 B 5 HIS H B 4 GLN HBy 1.0 0.0 3.56 238 182 B 5 HIS HD2 B 4 GLN HBx 1.0 0.0 4.73 239 182 B 5 HIS HD2 B 4 GLN HBy 1.0 0.0 4.73 240 183 B 5 HIS HD2 B 4 GLN HGy 1.0 0.0 4.14 241 183 B 5 HIS HD2 B 4 GLN HGx 1.0 0.0 4.14 242 184 B 5 HIS H B 5 HIS HBx 1.0 0.0 3.29 243 184 B 5 HIS H B 5 HIS HBy 1.0 0.0 3.29 244 185 B 5 HIS HD2 B 5 HIS HBx 1.0 0.0 3.47 245 185 B 5 HIS HD2 B 5 HIS HBy 1.0 0.0 3.47 246 186 B 7 CYS H B 7 CYS HBx 1.0 0.0 3.43 247 186 B 7 CYS H B 7 CYS HBy 1.0 0.0 3.43 248 187 B 8 ABA HBx B 7 CYS HBx 1.0 0.0 4.02 249 187 B 8 ABA HBx B 7 CYS HBy 1.0 0.0 4.02 250 188 B 8 ABA HBx B 9 SER HBx 1.0 0.0 4.22 251 188 B 8 ABA HBx B 9 SER HBy 1.0 0.0 4.22 252 189 B 9 SER H B 9 SER HBx 1.0 0.0 3.32 253 189 B 9 SER H B 9 SER HBy 1.0 0.0 3.32 254 190 B 10 HIS H B 9 SER HBx 1.0 0.0 4.14 255 190 B 10 HIS H B 9 SER HBy 1.0 0.0 4.14 256 191 B 10 HIS H B 10 HIS HBx 1.0 0.0 3.25 257 191 B 10 HIS H B 10 HIS HBy 1.0 0.0 3.25 258 192 B 14 ALA HB% B 10 HIS HBx 1.0 0.0 4.34 259 192 B 14 ALA HB% B 10 HIS HBy 1.0 0.0 4.34 260 193 B 11 LEU HA B 11 LEU HDx% 1.0 0.0 3.16 261 193 B 11 LEU HA B 11 LEU HDy% 1.0 0.0 3.16 262 194 B 11 LEU HBy B 15 LEU HDx% 1.0 0.0 5.19 263 194 B 11 LEU HBx B 15 LEU HDx% 1.0 0.0 5.19 264 194 B 15 LEU HDy% B 11 LEU HBx 1.0 0.0 5.19 265 194 B 15 LEU HDy% B 11 LEU HBy 1.0 0.0 5.19 266 195 B 15 LEU H B 11 LEU HDx% 1.0 0.0 4.32 267 195 B 15 LEU H B 11 LEU HDy% 1.0 0.0 4.32 268 196 B 11 LEU HDx% B 15 LEU HDx% 1.0 0.0 3.49 269 196 B 11 LEU HDy% B 15 LEU HDx% 1.0 0.0 3.49 270 196 B 15 LEU HDy% B 11 LEU HDx% 1.0 0.0 3.49 271 196 B 15 LEU HDy% B 11 LEU HDy% 1.0 0.0 3.49 272 197 B 12 VAL HA B 15 LEU HDx% 1.0 0.0 3.88 273 197 B 12 VAL HA B 15 LEU HDy% 1.0 0.0 3.88 274 198 B 12 VAL HGx% B 13 GLU HBx 1.0 0.0 4.87 275 198 B 12 VAL HGy% B 13 GLU HBx 1.0 0.0 4.87 276 198 B 13 GLU HBy B 12 VAL HGx% 1.0 0.0 4.87 277 198 B 12 VAL HGy% B 13 GLU HBy 1.0 0.0 4.87 278 199 B 12 VAL HGy% B 15 LEU HDx% 1.0 0.0 4.26 279 199 B 12 VAL HGx% B 15 LEU HDx% 1.0 0.0 4.26 280 199 B 15 LEU HDy% B 12 VAL HGx% 1.0 0.0 4.26 281 199 B 12 VAL HGy% B 15 LEU HDy% 1.0 0.0 4.26 282 200 B 13 GLU H B 13 GLU HBx 1.0 0.0 3.45 283 200 B 13 GLU H B 13 GLU HBy 1.0 0.0 3.45 284 201 B 13 GLU H B 13 GLU HGy 1.0 0.0 4.46 285 201 B 13 GLU H B 13 GLU HGx 1.0 0.0 4.46 286 202 B 13 GLU HA B 13 GLU HGy 1.0 0.0 3.35 287 202 B 13 GLU HA B 13 GLU HGx 1.0 0.0 3.35 288 203 B 14 ALA H B 13 GLU HBx 1.0 0.0 3.54 289 203 B 14 ALA H B 13 GLU HBy 1.0 0.0 3.54 290 204 B 13 GLU HBx B 17 LEU HDx% 1.0 0.0 5.34 291 204 B 13 GLU HBy B 17 LEU HDx% 1.0 0.0 5.34 292 204 B 17 LEU HDy% B 13 GLU HBx 1.0 0.0 5.34 293 204 B 17 LEU HDy% B 13 GLU HBy 1.0 0.0 5.34 294 205 B 14 ALA H B 13 GLU HGy 1.0 0.0 4.55 295 205 B 14 ALA H B 13 GLU HGx 1.0 0.0 4.55 296 206 B 17 LEU HG B 13 GLU HGy 1.0 0.0 4.76 297 206 B 17 LEU HG B 13 GLU HGx 1.0 0.0 4.76 298 207 B 13 GLU HGy B 17 LEU HDx% 1.0 0.0 3.78 299 207 B 13 GLU HGx B 17 LEU HDx% 1.0 0.0 3.78 300 207 B 17 LEU HDy% B 13 GLU HGy 1.0 0.0 3.78 301 207 B 17 LEU HDy% B 13 GLU HGx 1.0 0.0 3.78 302 208 B 14 ALA HA B 17 LEU HBx 1.0 0.0 3.78 303 208 B 14 ALA HA B 17 LEU HBy 1.0 0.0 3.78 304 209 B 15 LEU H B 15 LEU HDx% 1.0 0.0 4.04 305 209 B 15 LEU H B 15 LEU HDy% 1.0 0.0 4.04 306 210 B 15 LEU HA B 15 LEU HDx% 1.0 0.0 3.08 307 210 B 15 LEU HA B 15 LEU HDy% 1.0 0.0 3.08 308 211 B 16 TYR H B 15 LEU HDx% 1.0 0.0 4.48 309 211 B 16 TYR H B 15 LEU HDy% 1.0 0.0 4.48 310 212 B 18 VAL HB B 15 LEU HDx% 1.0 0.0 5.44 311 212 B 18 VAL HB B 15 LEU HDy% 1.0 0.0 5.44 312 213 B 18 VAL HGx% B 15 LEU HDx% 1.0 0.0 4.31 313 213 B 18 VAL HGx% B 15 LEU HDy% 1.0 0.0 4.31 314 214 B 19 CYS H B 15 LEU HDx% 1.0 0.0 4.84 315 214 B 19 CYS H B 15 LEU HDy% 1.0 0.0 4.84 316 215 A 2 ILE H B 15 LEU HDx% 1.0 0.0 5.44 317 215 A 2 ILE H B 15 LEU HDy% 1.0 0.0 5.44 318 216 A 2 ILE HB B 15 LEU HDx% 1.0 0.0 4.56 319 216 B 15 LEU HDy% A 2 ILE HB 1.0 0.0 4.56 320 217 A 2 ILE HD1% B 15 LEU HDx% 1.0 0.0 3.63 321 217 A 2 ILE HD1% B 15 LEU HDy% 1.0 0.0 3.63 322 218 B 16 TYR HA B 19 CYS HBx 1.0 0.0 4.56 323 218 B 16 TYR HA B 19 CYS HBy 1.0 0.0 4.56 324 219 B 16 TYR HE% B 21 GLU HGx 1.0 0.0 5.34 325 219 B 16 TYR HE% B 21 GLU HGy 1.0 0.0 5.34 326 220 B 18 VAL H B 17 LEU HBx 1.0 0.0 3.71 327 220 B 18 VAL H B 17 LEU HBy 1.0 0.0 3.71 328 221 B 18 VAL HGx% B 17 LEU HBx 1.0 0.0 4.77 329 221 B 18 VAL HGx% B 17 LEU HBy 1.0 0.0 4.77 330 222 B 19 CYS H B 19 CYS HBx 1.0 0.0 3.22 331 222 B 19 CYS H B 19 CYS HBy 1.0 0.0 3.22 332 223 B 20 GLY H B 19 CYS HBx 1.0 0.0 3.55 333 223 B 20 GLY H B 19 CYS HBy 1.0 0.0 3.55 334 224 A 2 ILE HD1% B 19 CYS HBx 1.0 0.0 3.78 335 224 A 2 ILE HD1% B 19 CYS HBy 1.0 0.0 3.78 336 225 B 21 GLU H B 21 GLU HGx 1.0 0.0 3.60 337 225 B 21 GLU H B 21 GLU HGy 1.0 0.0 3.60 338 226 B 21 GLU HA B 21 GLU HGx 1.0 0.0 3.50 339 226 B 21 GLU HA B 21 GLU HGy 1.0 0.0 3.50 340 227 B 22 ARG H B 21 GLU HGx 1.0 0.0 4.49 341 227 B 22 ARG H B 21 GLU HGy 1.0 0.0 4.49 342 228 B 22 ARG H B 22 ARG HGx 1.0 0.0 3.81 343 228 B 22 ARG H B 22 ARG HGy 1.0 0.0 3.81 344 229 A 2 ILE H A 1 GLY HAy 1.0 0.0 3.08 345 229 A 2 ILE H A 1 GLY HAx 1.0 0.0 3.08 346 230 A 2 ILE HD1% A 1 GLY HAy 1.0 0.0 4.18 347 230 A 2 ILE HD1% A 1 GLY HAx 1.0 0.0 4.18 348 231 A 2 ILE H A 2 ILE HB 1.0 0.0 3.62 349 232 A 3 VAL H A 2 ILE HB 1.0 0.0 3.90 350 233 A 3 VAL H A 3 VAL HB 1.0 0.0 3.35 351 234 A 4 GLU H A 3 VAL HB 1.0 0.0 3.63 352 235 A 4 GLU H A 4 GLU HBy 1.0 0.0 3.50 353 235 A 4 GLU H A 4 GLU HBx 1.0 0.0 3.50 354 236 A 5 GLN H A 4 GLU HBy 1.0 0.0 4.10 355 236 A 5 GLN H A 4 GLU HBx 1.0 0.0 4.10 356 237 A 6 CYS H A 6 CYS HBy 1.0 0.0 3.50 357 237 A 6 CYS H A 6 CYS HBx 1.0 0.0 3.50 358 238 B 7 CYS H B 10 HIS HBy 1.0 0.0 5.16 359 239 B 7 CYS H B 10 HIS HBy 1.0 0.0 5.00 360 240 B 11 LEU HA B 6 LEU HDx% 1.0 0.0 5.00 361 240 B 11 LEU HA B 6 LEU HDy% 1.0 0.0 5.00 362 241 A 2 ILE HB B 19 CYS HBy 1.0 0.0 5.00 363 242 A 2 ILE HB B 19 CYS HBx 1.0 0.0 5.00 364 243 B 17 LEU HBy B 1 PHE HE% 1.0 0.0 5.00 365 244 B 5 HIS HD2 B 4 GLN HGy 1.0 0.0 4.22 366 245 A 8 THR H A 6 CYS HBy 1.0 0.0 5.00 367 246 B 16 TYR HE% B 21 GLU HA 1.0 0.0 5.00 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type . save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 B 20 GLY H B 16 TYR O 1.0 1.8 2.0 2 2 B 16 TYR O B 20 GLY N 1.0 2.7 3.0 3 3 B 19 CYS H B 15 LEU O 1.0 1.8 2.0 4 4 B 15 LEU O B 19 CYS N 1.0 2.7 3.0 5 5 B 18 VAL H B 14 ALA O 1.0 1.8 2.0 6 6 B 14 ALA O B 18 VAL N 1.0 2.7 3.0 7 7 B 17 LEU H B 13 GLU O 1.0 1.8 2.0 8 8 B 13 GLU O B 17 LEU N 1.0 2.7 3.0 9 9 B 16 TYR H B 12 VAL O 1.0 1.8 2.0 10 10 B 12 VAL O B 16 TYR N 1.0 2.7 3.0 11 11 B 15 LEU H B 11 LEU O 1.0 1.8 2.0 12 12 B 11 LEU O B 15 LEU N 1.0 2.7 3.0 13 13 B 14 ALA H B 10 HIS O 1.0 1.8 2.0 14 14 B 10 HIS O B 14 ALA N 1.0 2.7 3.0 15 15 B 13 GLU H B 9 SER O 1.0 1.8 2.0 16 16 B 9 SER O B 13 GLU N 1.0 2.7 3.0 stop_ save_